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Network of interactions between drugs (red spheres) and targets (blue spheres) is displayed above.
The red lines are used for the predicted interactions and the thickness of edges indicate the confidence score of predictions.

Data source: DrugBank-all; Query type: chemical; # of requested predictions: 20; Secondary interactions: no
Input drug 1: DB04912
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image
1 Investigational SmallMoleculeDrug DB04912 Stannsoporfin Thumb


2 known interactions (targets) of input drug (DB04912): Stannsoporfin
No. Gene UniProt ID Protein Name Pathway PDB
1 HMOX1 P09601 Heme oxygenase 1 hsa00860; hsa01100; hsa04066; hsa04216; hsa04978; hsa05200; hsa05206; hsa05225; hsa05418
2 HMOX2 P30519 Heme oxygenase 2 hsa00860; hsa01100; hsa04978 2Q32; 2QPP; 2RGZ; 4WMH


20 predicted interactions (targets) of input drug (DB04912): Stannsoporfin
No. Gene UniProt ID Protein Name Pathway PDB Confidence score
1 CTSB P07858 Cathepsin B hsa04140; hsa04142; hsa04210; hsa04612; hsa04621; hsa04924 1CSB; 1GMY; 1HUC; 1PBH; 2IPP; 2PBH; 3AI8; 3CBJ; 3CBK; 3K9M; 3PBH 21.7%
2 PYGM P11217 Glycogen phosphorylase, muscle form hsa00500; hsa01100; hsa04217; hsa04910; hsa04922; hsa04931 1Z8D 19.4%
3 ADH1C P00326 Alcohol dehydrogenase 1C hsa00010; hsa00071; hsa00350; hsa00830; hsa00980; hsa00982; hsa01100; hsa05204 1DDA; 1HT0; 1U3W 18.9%
4 SCN10A Q9Y5Y9 Sodium channel protein type 10 subunit alpha NA NA 16.7%
5 ABCB1 P08183 Multidrug resistance protein 1 hsa02010; hsa04976; hsa05206; hsa05226 NA 16.7%
6 AKR1C2 P52895 Aldo-keto reductase family 1 member C2 hsa00140; hsa05204 1IHI; 1J96; 1XJB; 2HDJ; 2IPJ; 4JQ1; 4JQ2; 4JQ3; 4JQ4; 4JQA; 4JTQ; 4JTR; 4L1W; 4L1X 16.7%
7 SKP1 P63208 S-phase kinase-associated protein 1 hsa04110; hsa04114; hsa04120; hsa04141; hsa04310; hsa04350; hsa04710; hsa05168; hsa05170; hsa05200 1FQV; 1FS1; 1FS2; 1LDK; 1P22; 2ASS; 2AST; 2E31; 2E32; 2OVP; 2OVQ; 2OVR; 3L2O; 3WSO; 4I6J 16.5%
8 GSK3B P49841 Glycogen synthase kinase-3 beta hsa01521; hsa04012; hsa04062; hsa04110; hsa04150; hsa04151; hsa04310; hsa04340; hsa04360; hsa04390; hsa04510; hsa04550; hsa04657; hsa04660; hsa04662; hsa04722; hsa04728; hsa04910; hsa04916; hsa04917; hsa04919; hsa04931; hsa04932; hsa04934; hsa05010; hsa05160; hsa05162; hsa05163; hsa05164; hsa05165; hsa05166; hsa05167; hsa05169; hsa05200; hsa05210; hsa05213; hsa05215; hsa05217; hsa05224; hsa05225; hsa05226 16.3%
9 BLVRB P30043 Flavin reductase (NADPH) hsa00740; hsa00860; hsa01100 1HDO; 1HE2; 1HE3; 1HE4; 1HE5 15.6%
10 GLP1R P43220 Glucagon-like peptide 1 receptor hsa04024; hsa04080; hsa04911 3C59; 3C5T; 3IOL; 4ZGM 15.0%
11 ESR1 P03372 Estrogen receptor hsa01522; hsa04915; hsa04917; hsa04919; hsa04961; hsa05200; hsa05205; hsa05224 15.0%
12 HMGCR P04035 3-hydroxy-3-methylglutaryl-coenzyme A reductase hsa00900; hsa01100; hsa04152; hsa04976 14.6%
13 FDPS P14324 Farnesyl pyrophosphate synthase hsa00900; hsa01100; hsa05164; hsa05166 14.4%
14 CYP4A11 Q02928 Cytochrome P450 4A11 hsa00071; hsa00590; hsa00830; hsa01100; hsa03320; hsa04270; hsa04750 NA 14.1%
15 CDO1 Q16878 Cysteine dioxygenase type 1 hsa00270; hsa00430; hsa01100 2IC1 13.9%
16 KIT P10721 Mast/stem cell growth factor receptor Kit hsa04010; hsa04014; hsa04015; hsa04072; hsa04151; hsa04640; hsa04916; hsa05200; hsa05221; hsa05224; hsa05230 1PKG; 1QZJ; 1QZK; 1R01; 1T45; 1T46; 2E9W; 2EC8; 2VIF; 3G0E; 3G0F; 4HVS; 4K94; 4K9E; 4PGZ; 4U0I 13.8%
17 CHRNA2 Q15822 Neuronal acetylcholine receptor subunit alpha-2 hsa04080 NA 13.6%
18 DECR1 Q16698 2,4-dienoyl-CoA reductase, mitochondrial NA 1W6U; 1W73; 1W8D 13.5%
19 TH P07101 Tyrosine 3-monooxygenase hsa00350; hsa00790; hsa01100; hsa04728; hsa04917; hsa05012; hsa05030; hsa05031; hsa05034 2XSN; 4J6S 13.4%
20 GGPS1 O95749 Geranylgeranyl pyrophosphate synthase hsa00900; hsa01100 2Q80 13.0%


  logl

Reference:  Hongchun Li, Fen Pei, D. Lansing Taylor and Ivet Bahar. (2020) QuartataWeb: Integrated Chemical–Protein-Pathway Mapping for Polypharmacology and Chemogenomics. Bioinformatics 36(12), 3935–3937.

Contact:

The QuartataWeb server is maintained by the Bahar Lab at the Department of Computational & Systems Biology at the University of Pittsburgh, School of Medicine, and sponsored by the NIH awards P41 GM103712 and P01 DK096990; and by the Li Lab at Research Center for Computer-Aided Drug Discovery at Shenzhen Institutes of Advanced Technology, CAS.

For questions and comments please contact Hongchun Li.